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17-Methylstearic acid

CAT: 0804-HY-N7842-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N7842-01Size:1 mg
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Description
17-Methylstearic acid is a methyl-branched fatty acid that has been found in mouse meibomian glands, C. cornucopioides mushrooms, and Phytobacter species. It is also found in the aerial parts of C. ladanifer, where its concentration varies seasonally.
CAS Number
2724-59-6
Product Name Alternative
17-Methyloctadecanoic acid
UNSPSC
12352200
Hazard Statement
H315, H319, H335
Target
Biochemical Assay Reagents
Type
Biochemical Assay Reagents
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/17-methylstearic-acid.html
Solubility
10 mM in DMSO
Smiles
CC(C)CCCCCCCCCCCCCCCC(O)=O
Molecular Formula
C19H38O2
Molecular Weight
298.50
Precautions
H315, H319, H335
Shipping Conditions
Room Temperature
Storage Conditions
Store at room temperature 3 years
Scientific Category
Biochemical Assay Reagents
Clinical Information
No Development Reported

Chemical Information

17-Methyloctadecanoic acid

17-methyloctadecanoic acid is a branched-chain saturated fatty acid that is octadecanoic (stearic) acid carrying a methyl substituent at position 17. It is a long-chain fatty acid, a branched-chain saturated fatty acid and a methyl-branched fatty acid. It is functionally related to an octadecanoic acid. It is a conjugate acid of a 17-methyloctadecanoate.

CAS Number2724-59-6
PubChem CID3083779
IUPAC Name17-methyloctadecanoic acid
Molecular FormulaC19H38O2
Molecular Weight298.5
XLogP7.7
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count16
Heavy Atom Count21
Formal Charge0
Complexity224
SMILES
CC(C)CCCCCCCCCCCCCCCC(=O)O
InChI
InChI=1S/C19H38O2/c1-18(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19(20)21/h18H,3-17H2,1-2H3,(H,20,21)
InChIKey
YETXGSGCWODRAA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 17-Methyloctadecanoic acid
CAS: 2724-59-6
CID: 3083779
Formula: C19H38O2
MW: 298.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight298.5
XLogP37.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count16
Exact Mass298.287180451
Monoisotopic Mass298.287180451
Topological Polar Surface Area37.3 Ų
Heavy Atom Count21
Formal Charge0
Complexity224
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes